4-tert-butyl-N-(3-morpholin-4-ium-4-ylpropyl)-N-[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 4-tert-butyl-N-(3-morpholin-4-ium-4-ylpropyl)-N-[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl]benzamide Openeye Name: 4-tert-butyl-N-[2-(isoxazol-3-ylamino)-2-oxo-ethyl]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide CAS Name: 4-tert-butyl-N-[2-(3-isoxazolylamino)-2-oxoethyl]-N-[3-(4-morpholin-4-iumyl)propyl]benzamide IUPAC Name: 4-tert-butyl-N-(3-morpholin-4-ium-4-ylpropyl)-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]benzamide Traditional Name: 4-tert-butyl-N-[2-(isoxazol-3-ylamino)-2-keto-ethyl]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Formula: C23H33N4O4+ MolecularWeight: 429.53252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N(CCC[NH+]2CCOCC2)CC(=O)NC3=NOC=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N(CCC[NH+]2CCOCC2)CC(=O)NC3=NOC=C3

InChI

InChI=1S/C23H32N4O4/c1-23(2,3)19-7-5-18(6-8-19)22(29)27(11-4-10-26-12-15-30-16-13-26)17-21(28)24-20-9-14-31-25-20/h5-9,14H,4,10-13,15-17H2,1-3H3,(H,24,25,28)/p+1